3,3,5,8-tetramethyl-4-oxidanylidene-2H-thiochromene-6-carboxylic acid

Systemtic Name: 3,3,5,8-tetramethyl-4-oxidanylidene-2H-thiochromene-6-carboxylic acid Openeye Name: 3,3,5,8-tetramethyl-4-oxo-thiochromane-6-carboxylic acid CAS Name: 3,3,5,8-tetramethyl-4-oxo-2H-1-benzothiopyran-6-carboxylic acid IUPAC Name: 3,3,5,8-tetramethyl-4-oxo-2H-thiochromene-6-carboxylic acid Traditional Name: 4-keto-3,3,5,8-tetramethyl-thiochroman-6-carboxylic acid Formula: C14H16O3S MolecularWeight: 264.34004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1)C(=O)O)C)C(=O)C(CS2)(C)C

Isomeric SMILES

CC1=C2C(=C(C(=C1)C(=O)O)C)C(=O)C(CS2)(C)C

InChI

InChI=1S/C14H16O3S/c1-7-5-9(13(16)17)8(2)10-11(7)18-6-14(3,4)12(10)15/h5H,6H2,1-4H3,(H,16,17)